Information card for entry 4134276

Structure parameters

• Formula: C5 H9 F I3 N Pb
• Calculated formula: C5 H9 F I3 N Pb
• Title of publication: Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric.
• Authors of publication: Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 8.0887 ± 0.001 Å
• b: 10.4653 ± 0.0014 Å
• c: 14.9244 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1263.4 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.2227
• Residual factor for significantly intense reflections: 0.2091
• Weighted residual factors for significantly intense reflections: 0.5026
• Weighted residual factors for all reflections included in the refinement: 0.5216
• Goodness-of-fit parameter for all reflections included in the refinement: 2.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No